SCHEMBL4371959

SCHEMBL4371959

N#Cc1ccc(Oc2ccc(F)cc2Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.50
MERTK Q12866 1/20 0.49
SCN9A Q15858 1/20 0.46
EGFR P00533 1/20 0.45
ERBB2 P04626 1/20 0.45
ERBB3 P21860 1/20 0.45
ERBB4 Q15303 1/20 0.45
SLC6A4 P31645 4/20 0.44
HTR2A P28223 3/20 0.44
KCNH2 Q12809 3/20 0.44
FFAR1 O14842 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
SLC22A12 Q96S37 1/20 0.43
EGLN2 Q96KS0 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
TBXA2R P21731 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4374224 0.90 AR (0.57) ARMERTKSCN9AEGFRERBB2
SCHEMBL11649803 0.83 SLC6A4 (0.57) ARMERTKEGFRERBB2ERBB3
SCHEMBL4368827 0.83 AR (0.58) ARMERTKSCN9AERBB2SLC6A4
SCHEMBL8545187 0.81 MERTK (0.55) ARMERTKSCN9AEGFRERBB2
SCHEMBL2788214 0.81 AR (0.55) ARMERTKSCN9AEGFRERBB2
SCHEMBL11424391 0.81 MERTK (0.49) ARMERTKSCN9AEGFRERBB2
SCHEMBL921021 0.80 FFAR1 (0.54) ARMERTKSLC6A4HTR2AKCNH2
SCHEMBL5897452 0.80 SLC6A4 (0.54) ARMERTKSLC6A4
SCHEMBL4188121 0.79 AR (0.60) ARSLC6A4KCNH2FFAR1SLC6A2
SCHEMBL31264488 0.78 PDE7A (0.56) SCN9ASLC6A4HTR2AKCNH2SLC6A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009117421-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-09-24 WO disclosed